SCHEMBL1764779

SCHEMBL1764779

NCc1cc(F)c(Cl)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.39
KDM1B Q8NB78 1/20 0.39
PNMT P11086 2/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
GPR84 Q9NQS5 1/20 0.37
HTR2C P28335 6/20 0.37
HTR2B P41595 6/20 0.37
HTR2A P28223 5/20 0.37
ALDH1A1 P00352 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
DPP4 P27487 1/20 0.34
SLC6A3 Q01959 2/20 0.33
SLC6A4 P31645 2/20 0.33
TAAR1 Q96RJ0 2/20 0.33
KCNH2 Q12809 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1764780 0.88 PNMT (0.41) KDM1AKDM1BPNMTLOXL2HTR2C
SCHEMBL15632160 0.84 TAAR1 (0.45) KDM1AKDM1BPNMTGPR84HTR2C
SCHEMBL30350517 0.81 PNMT (0.39) KDM1AKDM1BPNMTLOXL2GPR84
SCHEMBL1765257 0.81 PNMT (0.39) KDM1AKDM1BPNMTLOXL2GPR84
SCHEMBL29976628 0.80 KDM1A (0.49) KDM1AKDM1BPNMTLOXL2DPP4
SCHEMBL16794042 0.80 KDM1A (0.49) KDM1AKDM1BPNMTLOXL2DPP4
SCHEMBL626553 0.79 PNMT (0.50) PNMTDPP4TAAR1
SCHEMBL18309990 0.79 KDM1A (0.35) KDM1AKDM1BPNMTLOXL2GPR84
Hydrochloric Acid SCHEMBL2549784 0.79 KDM1A (0.47) KDM1AKDM1BPNMTLOXL2HTR2C
SCHEMBL31010415 0.78 KDM1A (0.41) KDM1AKDM1BGPR84HTR2CHTR2B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4618985-A1 DUAL INHIBITORS OF SIGMA-1 RECEPTOR AND SOLUBLE EPOXIDE HYDROLASE AND THEIR USE IN THE TREATMENT OF PAIN Universitat De Barcelona (ES) 2025-09-24 EP disclosed
WO-2024105234-A1 DUAL INHIBITORS OF SIGMA-1 RECEPTOR AND SOLUBLE EPOXIDE HYDROLASE AND THEIR USE IN THE TREATMENT OF PAIN UNIVERSITAT DE BARCELONA (ES) 2024-05-23 WO disclosed
CN-102753538-B Sultam derivatives HOFFMANN LA ROCHE 2015-04-08 CN disclosed
EP-2504324-B1 SULTAM DERIVATIVES HOFFMANN LA ROCHE (CH) 2015-02-25 EP disclosed
US-8314250-B2 Sultam derivatives HOFFMANN-LA ROCHE INC. (US) 2012-11-20 US disclosed
EP-2504324-A1 SULTAM DERIVATIVES F. Hoffmann-La Roche AG (CH) 2012-10-03 EP disclosed
WO-2011064141-A1 SULTAM DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-06-03 WO disclosed
US-20110124686-A1 SULTAM DERIVATIVES ANDERSON KEVIN W 2011-05-26 US disclosed
US-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 US disclosed
US-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 US disclosed
US-20090182142-A1 Aromatic Compound FURUKUBO SHIGERU 2009-07-16 US disclosed
US-20090182142-A1 Aromatic Compound FURUKUBO SHIGERU 2009-07-16 US disclosed
EP-1970373-A1 ALICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2008-09-17 EP disclosed
EP-1956009-A1 AROMATIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2008-08-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090182140-A1 Alicyclic Heterocyclic Compound CCR4, CCR1, HRH4 KDM1A 1097/4885KDM1B 652/4885PNMT 3779/4885
US-20090182142-A1 Aromatic Compound HRH4, CCR4, HRH3 KDM1A 1513/4885KDM1B 1195/4885PNMT 3678/4885
US-20110124686-A1 SULTAM DERIVATIVES SULT1A1, SULT2A1, SULT1E1 KDM1A 1432/4885KDM1B 1866/4885PNMT 355/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.